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5813-89-8,MFCD00010425
Catalog No.:AA00EA96

5813-89-8 | 2-THIOPHENECARBOXAMIDE

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1g
98%
in stock  
$11.00   $8.00
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5g
98%
in stock  
$35.00   $25.00
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25g
98%
in stock  
$121.00   $85.00
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  • Technical Information
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  • Literature
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  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA00EA96
Chemical Name:
2-THIOPHENECARBOXAMIDE
CAS Number:
5813-89-8
Molecular Formula:
C5H5NOS
Molecular Weight:
127.1643
MDL Number:
MFCD00010425
SMILES:
C1=CSC(=C1)C(=O)N
NSC Number:
109369
Properties
Properties
 
Form:
Solid  
MP:
181-183°C(lit.)  
Refractive Index:
1.5480 (estimate)  
Storage:
Keep in dry area;2-8℃;  

Computed Properties
 
Complexity:
105  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
1  
XLogP3:
0.5  

Literature

Title: Discovery of checkpoint kinase inhibitor (S)-5-(3-fluorophenyl)-N-(piperidin-3-yl)-3-ureidothiophene-2-carboxamide (AZD7762) by structure-based design and optimization of thiophenecarboxamide ureas.

Journal: Journal of medicinal chemistry 20120614

Title: Benzo[1,2-b:4,5-b']dithio-phene-4,8-dione.

Journal: Acta crystallographica. Section E, Structure reports online 20120501

Title: Synthesis and evaluation of 2-amido-3-carboxamide thiophene CB₂ receptor agonists for pain management.

Journal: Bioorganic & medicinal chemistry letters 20120401

Title: Pharmacological classification and activity evaluation of furan and thiophene amide derivatives applying semi-empirical ab initio molecular modeling methods.

Journal: International journal of molecular sciences 20120101

Title: Triazole ring-opening leads to the discovery of potent nonsteroidal 17β-hydroxysteroid dehydrogenase type 2 inhibitors.

Journal: European journal of medicinal chemistry 20111201

Title: SBA-15-type organosilica with 4-mercapto-N,N-bis-(3-Si-propyl)butanamide for palladium scavenging and cross-coupling catalysis.

Journal: Chemistry (Weinheim an der Bergstrasse, Germany) 20110801

Title: Identification of human IKK-2 inhibitors of natural origin (part I): modeling of the IKK-2 kinase domain, virtual screening and activity assays.

Journal: PloS one 20110101

Title: A facile and convenient synthesis of some novel hydrazones, Schiff's base and pyrazoles incorporating thieno[2,3-b]thiophenes.

Journal: International journal of molecular sciences 20110101

Title: Two branched polar groups and polar linker moieties of thiophene amide derivatives are essential for MRP2/ABCC2 recognition.

Journal: Drug metabolism letters 20101201

Title: Disruption of microtubules sensitizes the DNA damage-induced apoptosis through inhibiting nuclear factor κB (NF-κB) DNA-binding activity.

Journal: Journal of Korean medical science 20101101

Title: Polymerizable Well-Defined Oligo(thiophene amide)s and their ROMP Block Copolymers.

Journal: Macromolecular rapid communications 20090716

Title: 2-Amino-N-(2-methoxy-phen-yl)-4,5-dimethyl-thio-phene-3-carboxamide.

Journal: Acta crystallographica. Section E, Structure reports online 20080701

Title: Rare earth metal complexes bearing thiophene-amido ligand: synthesis and structural characterization.

Journal: Dalton transactions (Cambridge, England : 2003) 20071028

Title: Inhibition of endothelial cell proliferation by per-O-acetylated mannose conjugates.

Journal: Anticancer research 20070101

Title: N-Glycosyl-thiophene-2-carboxamides: synthesis, structure and effects on the growth of diverse cell types.

Journal: Carbohydrate research 20060724

Title: Prediction of genotoxicity of chemical compounds by statistical learning methods.

Journal: Chemical research in toxicology 20050601

Title: Hit-to-lead studies: the discovery of potent, orally active, thiophenecarboxamide IKK-2 inhibitors.

Journal: Bioorganic & medicinal chemistry letters 20040607

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